N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(4-methoxyphenyl)ethanamide

Systemtic Name: N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(4-methoxyphenyl)acetamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C20H22BrN3O4S/c1-3-13-6-9-17(16(21)10-13)28-12-19(26)23-24-20(29)22-18(25)11-14-4-7-15(27-2)8-5-14/h4-10H,3,11-12H2,1-2H3,(H,23,26)(H2,22,24,25,29)